33342-05-1
Product Name:
Gliquidone
Formula:
C27H33N3O6S
Synonyms:
2-{2-[4-({[(cyclohexylamino)carbonyl]amino}sulfonyl)phenyl]ethyl}-7-methoxy-4,4-dimethyl-1,3-dioxo-1,2,3,4-tetrahydroisoquinoline
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
---|---|
Melting Point | 180-182 |
Solubility | 69.5 [ug/mL] (The mean of the results at pH 7.4) |
LogP | 4.5 |
COMPUTED DESCRIPTORS
Molecular Weight | 527.6 g/mol |
---|---|
XLogP3 | 4.6 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 6 |
Rotatable Bond Count | 7 |
Exact Mass | 527.20900695 g/mol |
Monoisotopic Mass | 527.20900695 g/mol |
Topological Polar Surface Area | 130 Ų |
Heavy Atom Count | 37 |
Formal Charge | 0 |
Complexity | 948 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
1-cyclohexyl-3-[4-[2-(7-methoxy-4,4-dimethyl-1,3-dioxo-2-isoquinolinyl)ethyl]phenyl]sulfonylurea is a member of isoquinolines.